%chk=000018107.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018107

0 1
 O  -7.6200001E-02  -2.476200       1.693700    
 N   -3.051200       1.359200      0.4154000    
 N    1.744400      -2.636800      0.3207000    
 C   9.1399997E-02 -0.8549000     -0.1428000    
 C   -1.228300     -0.2812000      0.4806000    
 C  -0.1747000      -1.390900      -1.589400    
 C    1.186100      0.2379000     -8.0600001E-02
 C   -1.833300      0.9187000     -0.2597000    
 C   0.5583000      -2.059700      0.7248000    
 C   -1.215800      -2.503600      -1.695600    
 C    1.502600      0.7590000       1.143600    
 C    1.776500      0.6214000      -1.253000    
 C   -4.027000      0.2706000      0.4752000    
 C   -3.624300       2.520300     -0.2660000    
 C    2.489100       1.743500       1.199800    
 C    2.763100       1.605900      -1.196600    
 C    3.119300       2.166900      2.9899999E-02
 H   -1.072800     -6.0999999E-03   1.532700    
 H   -1.939600      -1.112800      0.5155000    
 H  -0.4939000     -0.5798000      -2.254600    
 H   0.7486000      -1.797500      -2.022400    
 H   -1.111600       1.743200     -0.2678000    
 H   -2.047900      0.6604000      -1.302800    
 H  -0.9661000      -3.361000      -1.064500    
 H   -1.268300      -2.860700      -2.729800    
 H   -2.214700      -2.149400      -1.426800    
 H    1.036700      0.4328000       2.066700    
 H    1.541400      0.2253000      -2.231500    
 H    2.130600      -3.431100      0.8200000    
 H    2.282300      -2.294700     -0.4685000    
 H   -3.758700     -0.4797000       1.225100    
 H   -4.176200     -0.2167000     -0.4953000    
 H   -5.002100      0.6513000      0.8044000    
 H   -3.922400       2.290700      -1.295500    
 H   -2.904700       3.346400     -0.2912000    
 H   -4.503300       2.889800      0.2740000    
 H    2.769300       2.177900       2.155100    
 H    3.254300       1.936600      -2.107100    
 H    3.888100       2.932800      7.3799998E-02


%chk=000018107-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000018107

0 1
O -0.246013 -2.898198 1.319503
N -3.027485 1.354592 0.373368
N 1.895994 -2.482994 0.555962
C 0.077698 -0.943414 -0.196812
C -1.262314 -0.432155 0.423331
C -0.139548 -1.478693 -1.658988
C 1.147499 0.174454 -0.146977
C -1.937211 0.692898 -0.385888
C 0.550073 -2.175204 0.649094
C -1.206494 -2.583472 -1.805731
C 1.525752 0.708373 1.117928
C 1.775268 0.708827 -1.302319
C -4.159021 0.452839 0.673112
C -3.481190 2.590042 -0.297074
C 2.484125 1.736267 1.224354
C 2.738032 1.742004 -1.200413
C 3.096893 2.262070 0.061514
H -1.072422 -0.045570 1.441172
H -1.927795 -1.302966 0.543864
H -0.421778 -0.624776 -2.304276
H 0.827325 -1.860469 -2.043412
H -1.186334 1.470833 -0.624471
H -2.317448 0.290424 -1.363187
H -0.998310 -3.446743 -1.150571
H -1.234821 -2.942435 -2.851022
H -2.215541 -2.211326 -1.553658
H 1.065077 0.309318 2.029694
H 1.518271 0.329596 -2.295794
H 2.240386 -3.307648 1.047031
H 2.555663 -1.852243 0.101888
H -3.821256 -0.396415 1.289698
H -4.648367 0.041766 -0.248801
H -4.924215 1.004185 1.248383
H -3.941626 2.408320 -1.303224
H -2.625233 3.275283 -0.432372
H -4.232557 3.100628 0.332022
H 2.753693 2.128101 2.211645
H 3.203708 2.138867 -2.109874
H 3.840522 3.062833 0.140799


